smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1c(C)[n+]([O-])c([C@H](c2ccc([N+](=O)[O-])cc2)c2c([O-])[nH]c(=O)[n-]c2=O)n1CCO	ZINC000524732610	569213191	/nfs/dbraw/zinc/21/31/91/569213191.db2.gz	RFUJLYBLEIXAMB-CYBMUJFWSA-N	-2	3	417.378	-0.247	50	5		HBBAHL
Cc1c(C)[n+]([O-])c([C@@H](c2ccc([N+](=O)[O-])cc2)c2c([O-])[nH]c(=O)[n-]c2=O)n1CCO	ZINC000524732612	569213202	/nfs/dbraw/zinc/21/32/02/569213202.db2.gz	RFUJLYBLEIXAMB-ZDUSSCGKSA-N	-2	3	417.378	-0.247	50	5		HBBAHL